N-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
Chemical Structure Depiction of
N-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
N-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
Compound characteristics
| Compound ID: | S555-1479 |
| Compound Name: | N-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C22 H24 N2 O4 |
| Smiles: | COc1cccc(CC(N2CCOc3ccc(cc3C2)NC(C2CC2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2707 |
| logD: | 3.2707 |
| logSw: | -3.3536 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.462 |
| InChI Key: | IYPSNYQBXGCIJV-UHFFFAOYSA-N |